- Building Grid Computing Environments for Computational Science Research
- Computational Modeling of Virus Processes
- Conical Intersections and Rare Events in Photochemistry
- Development of a Workflow Infrastructure for High-throughput Computational Chemistry
- Efficient and Reliable Optimization of Spin Glass Systems and Other Hard Problems
- Efficient Map-matching of GPS Data
- Evolutionary Game Theory
- Exploring Similarities of Adaptation Techniques in Evolutionary Algorithms and Monte Carlo Markov Chains Algorithms
- Finite-element Based Microscopic Description of a Solvent
- Flow Simulations Using Particle Vortex Methods
- Integration of Traffic and Activity Models
- Large Scale Properties of Biochemical Networks and their Evolution
- Monte Carlo Algorithms: Beyond Metropolis
- Multi-Objective Evolutionary Algorithms (MOEA)
- Parameterization of a Group Difference Pseudopotential Using Grid Computing
- Quantifying Thermodynamic Properties of Multi-component Silicate Melts Using Multi-Objective Optimization
- Quantum Chemical and Continuum Electrostatics Calculations on Catalytic Antibodies
- Regulatory Network Project
- Simulation of Activity Decisions
- Simulations of Novel Exotic Phases of Matter